Information card for entry 4503026

Structure parameters

• Formula: C14 H12 N O10 Zn1.5
• Calculated formula: C14 H12 N O10 Zn1.5
• Title of publication: Role of Temperature on Framework Dimensionality: Supramolecular Isomers of Zn3(RCOO)8Based Metal Organic Frameworks
• Authors of publication: Nagarkar, Sanjog S.; Chaudhari, Abhijeet K.; Ghosh, Sujit K.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 2
• Pages of publication: 572
• a: 9.426 ± 0.005 Å
• b: 15.424 ± 0.005 Å
• c: 17.359 ± 0.005 Å
• α: 90°
• β: 92.474 ± 0.005°
• γ: 90°
• Cell volume: 2521.4 ± 1.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1152
• Residual factor for significantly intense reflections: 0.1038
• Weighted residual factors for significantly intense reflections: 0.3378
• Weighted residual factors for all reflections included in the refinement: 0.3523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.525
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No